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Isothiochroman

View entire compound with spectra: 5 NMR, and 1 MS (GC)

Isothiochroman
SpectraBase Compound ID DzZmYPDYMVv
InChI InChI=1S/C9H10S/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4H,5-7H2
InChIKey ZZQUQFZVCJWSER-UHFFFAOYSA-N
Mol Weight 150.24 g/mol
Molecular Formula C9H10S
Exact Mass 150.050321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5yLOw23iQsc
Name ISOTHIOCHROMAN
CAS Registry Number 4426-75-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H10S
InChI InChI=1S/C9H10S/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4H,5-7H2
InChIKey ZZQUQFZVCJWSER-UHFFFAOYSA-N
Literature Reference Author W.ADCOCK,B.D.GUPTA,W.KITCHING
Literature Reference Citation J.ORG.CHEM.,41,1498(1976)
Literature Reference DOI 10.1021/jo00871a003
Molecular Weight 150.238 g/mol
Solvent CDCl3
Source File Reference UNIW9730